ASE database

Displaying rows 51-75 out of 594

↓ ID ✕	Formula ✕	ads_site ✕	Number of atoms ✕	atom_E ✕	ads_E ✕	str_E ✕	Dipole_val ✕
51	Au₅₄P	0t	55	-1.888	-1.663	-168.614	0.133
52	Au₅₄S	0t	55	-0.945	-2.279	-168.287	1.591
53	Au₅₄Cl	0t	55	-0.243	-2.402	-167.708	2.287
54	Au₅₄Ar	0t	55	-0.025	-0.003	-165.092	-0.102
55	Au₇₂H	2f	73	-1.117	-1.683	-221.327	-0.181
56	Au₇₂He	2f	73	0.002	-0.005	-218.530	-0.016
57	Au₇₂Li	2f	73	-0.299	-2.954	-221.779	-1.996
58	Au₇₂Be	2f	73	-0.039	-3.785	-222.351	-0.158
59	Au₇₂B	2f	73	-0.349	-5.089	-223.965	0.170
60	Au₇₂C	2f	73	-1.248	-4.383	-224.158	0.284
61	Au₇₂N	2f	73	-3.124	-2.009	-223.660	0.438
62	Au₇₂O	2f	73	-1.533	-2.954	-223.013	0.578
63	Au₇₂F	2f	73	-0.424	-3.008	-221.958	1.101
64	Au₇₂Ne	2f	73	-0.013	-0.008	-218.548	-0.007
65	Au₇₂Na	2f	73	-0.225	-2.503	-221.255	-3.683
66	Au₇₂Mg	2f	73	-0.004	-2.706	-221.237	-1.984
67	AlAu₇₂	2f	73	-0.295	-4.343	-223.165	-0.572
68	Au₇₂Si	2f	73	-0.830	-4.977	-224.334	-0.022
69	Au₇₂P	2f	73	-1.888	-3.831	-224.246	0.189
70	Au₇₂S	2f	73	-0.945	-3.509	-222.981	0.303
71	Au₇₂Cl	2f	73	-0.243	-2.405	-221.174	1.191
72	Au₇₂Ar	2f	73	-0.025	-0.002	-218.555	-0.072
73	Au₇₂H	3b	73	-1.117	-1.957	-221.601	-0.028
74	Au₇₂He	3b	73	0.002	-0.005	-218.530	-0.021
75	Au₇₂Li	3b	73	-0.299	-2.846	-221.672	-2.222

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